mp_ID stringlengths 4 10 | x float64 -10.28 17.7 | y float64 -12.01 23.9 | z float64 -8.99 7.96 | type stringclasses 2
values | formula stringlengths 2 26 | n_atoms int64 1 444 | spacegroup int64 1 230 | volume float64 5.61 20.1k |
|---|---|---|---|---|---|---|---|---|
mp-975531 | -6.436263 | -2.806304 | -1.751161 | other | Rb1Cr5Te8 | 14 | 12 | 390.31 |
mp-685138 | -4.606314 | -3.484298 | -0.197211 | other | U4As2Se2 | 8 | 12 | 193.06 |
mp-697962 | 3.431042 | -0.680726 | -2.476738 | other | Eu6Mg7H26 | 39 | 12 | 439.81 |
mp-756286 | 9.849608 | 8.565667 | 3.069667 | other | La3Ce4O12 | 19 | 12 | 304.76 |
mp-1025347 | -4.850216 | -1.446511 | -3.122925 | other | Ti2Co1Se4 | 7 | 12 | 129.25 |
mp-764457 | 5.51297 | 10.41463 | -1.952941 | other | Na12Fe4O16 | 32 | 12 | 348.44 |
mp-1182448 | 6.094258 | 11.739739 | -1.002775 | other | Ba4Fe9O20 | 33 | 12 | 450.4 |
mp-1222857 | -7.524199 | -10.206963 | 6.283996 | other | La1Mg11Al1 | 13 | 12 | 308.28 |
mp-777674 | 10.099116 | 0.596758 | 0.404655 | other | Li4Fe4F16 | 24 | 12 | 323.13 |
mp-37255 | 8.768196 | 11.484808 | 0.359943 | other | Na4Ru2O6 | 12 | 12 | 132.63 |
mp-1246594 | 0.509515 | 2.702412 | 1.735046 | other | Mn2Ni9N8 | 19 | 12 | 176.22 |
mp-1237970 | -4.838412 | -2.954992 | -3.876622 | other | Mg2In2Se6 | 10 | 12 | 288.03 |
mp-1232192 | -4.537866 | -3.926532 | -3.921833 | other | Dy4Mg4Se12 | 20 | 12 | 587.67 |
mp-1223222 | -0.956213 | 0.752103 | -1.59654 | other | La4C2I5 | 11 | 12 | 367.98 |
mp-1084850 | 6.687793 | 5.849528 | -3.81753 | other | Ni1Cl2O6 | 9 | 12 | 135.52 |
mp-1180080 | 6.714509 | 5.793396 | -3.848122 | other | Ni1Cl2O6 | 9 | 12 | 154.19 |
mp-1104112 | 12.4168 | 11.941896 | 1.85843 | other | Li2Ti4O8 | 14 | 12 | 152.32 |
mp-17759 | 7.811384 | 10.058735 | -3.731723 | other | Cr4Cd4O16 | 24 | 12 | 352.81 |
mp-1025023 | -0.647422 | 0.77645 | -2.38712 | other | Tb2C2Br2 | 6 | 12 | 135.85 |
mp-4022 | -5.468406 | -2.854923 | 4.747145 | other | Zr4Co2Si4 | 10 | 12 | 159.81 |
mp-1193337 | -4.69405 | -2.953176 | -3.791406 | other | Cs10Ga6Se14 | 30 | 12 | 1,108.33 |
mp-976257 | -4.834826 | -1.612746 | -3.076351 | other | K1Ti5Se8 | 14 | 12 | 307.6 |
mp-2874 | 12.589278 | 6.626256 | -0.905703 | other | In2Si2O7 | 11 | 12 | 132.21 |
mp-780623 | 14.198379 | 12.763762 | -1.310758 | other | V8O12F4 | 24 | 12 | 246.7 |
mp-704810 | 7.807666 | 9.983973 | -3.823642 | other | K4Cr4O14 | 22 | 12 | 437.66 |
mp-2647164 | 8.469448 | 3.887675 | -6.938125 | other | Mg12C12O36 | 60 | 12 | 546.66 |
mp-1245863 | 0.146052 | 2.631479 | 1.95634 | other | Mg1Fe10N8 | 19 | 12 | 192.63 |
mp-31069 | 10.638173 | 7.624465 | -2.080366 | other | P4Pb16O26 | 46 | 12 | 831.31 |
mp-2214642 | 8.715481 | 14.071849 | -1.576216 | other | Mn3Sb1O8 | 12 | 12 | 158.97 |
mp-1045474 | -5.138959 | -0.733109 | -5.158434 | other | Mg2Mn4S8 | 14 | 12 | 246.8 |
mp-1080184 | 8.333399 | 6.633784 | -2.774386 | other | La2I2O6 | 10 | 12 | 196.11 |
mp-561672 | 8.500946 | 9.1838 | -0.258618 | other | Cs4Ir1O4 | 9 | 12 | 224.02 |
mp-1227449 | -5.428318 | -1.032156 | 4.661376 | other | Be5Al4Fe2 | 11 | 12 | 125 |
mp-29741 | -5.681547 | -6.120431 | 0.771859 | other | Tl4Cd6Sb6 | 16 | 12 | 478.74 |
mp-608594 | 12.239521 | 11.568973 | -1.372285 | other | Cr2W2O8 | 12 | 12 | 132.71 |
mp-14474 | -4.567274 | -1.093964 | -3.241662 | other | Ta4Pt2Se14 | 20 | 12 | 502.6 |
mp-1215038 | 8.290307 | 1.212818 | 0.453983 | other | Ba3Ti1F12 | 16 | 12 | 418.13 |
mp-1398363 | 12.914643 | 10.589074 | 0.053014 | other | Zn2W3O8 | 13 | 12 | 160.72 |
mp-1225679 | -8.286176 | -4.609538 | 5.386385 | other | Er2Ga2Ni2 | 6 | 12 | 106.25 |
mp-1045074 | 6.772678 | 13.417011 | -1.947922 | other | Al4Co12O24 | 40 | 12 | 414.35 |
mp-557297 | 10.959786 | 10.79976 | -3.537019 | other | Tl3Mo10O30 | 43 | 12 | 672.5 |
mp-1223942 | -9.025927 | -6.103532 | 3.575859 | other | Ho2Ga2Au2 | 6 | 12 | 121.51 |
mp-1245443 | 1.671494 | 1.787202 | 1.283409 | other | Ca7Zn2N6 | 15 | 12 | 247.84 |
mp-766308 | -1.240584 | 1.935727 | -1.709702 | other | Ba4Ca4I16 | 24 | 12 | 1,370.64 |
mp-753802 | 10.605126 | 10.598757 | 3.126145 | other | Sc2Ti2O7 | 11 | 12 | 144.95 |
mp-1101384 | 10.762783 | 9.283646 | -0.568438 | other | Sb10O14F2 | 26 | 12 | 509.3 |
mp-1370001 | 7.754665 | 13.293816 | -1.296233 | other | Ca2Co9O13 | 24 | 12 | 250.67 |
mp-1100486 | 7.147183 | 19.649796 | -0.122213 | other | Li9Mn7O16 | 32 | 12 | 297.59 |
mp-1101885 | -2.391893 | -0.59192 | -5.476224 | other | Na4P2S6 | 12 | 12 | 270.33 |
mp-15886 | -3.019422 | -2.298388 | -4.808939 | other | Na4U2S6 | 12 | 12 | 276.66 |
mp-1224415 | -5.744568 | -3.451181 | -2.074852 | other | Ge3Sb2Te6 | 11 | 12 | 337.06 |
mp-1205905 | -7.667462 | -3.240124 | 5.462797 | other | Dy4Ge4Ru2 | 10 | 12 | 204.66 |
mp-753132 | 11.27396 | 12.379652 | 0.094393 | other | Ca1Mn7O8 | 16 | 12 | 187.65 |
mp-1208866 | -3.506467 | -3.452915 | 0.879532 | other | Si2P4Ir1 | 7 | 12 | 117.56 |
mp-568349 | -5.729413 | -1.653775 | -3.235644 | other | Cr1Fe2Se4 | 7 | 12 | 124.69 |
mp-1208717 | 13.222872 | 7.719015 | -1.198654 | other | Ti1B6O6 | 13 | 12 | 171.39 |
mp-31107 | 10.384336 | 7.998769 | -1.860455 | other | As4Pb16O26 | 46 | 12 | 831.11 |
mp-764889 | 8.319014 | 13.789976 | -0.694437 | other | Li9Fe5O12 | 26 | 12 | 243.21 |
mp-1228055 | -5.79375 | -6.84259 | 3.417801 | other | Ba2In2Ga2 | 6 | 12 | 181.23 |
mp-25248 | 7.593602 | 11.875546 | -0.64664 | other | Li8Cu6O12 | 26 | 12 | 275.35 |
mp-764764 | 6.886322 | 19.817789 | -0.211125 | other | Li14Mn10O24 | 48 | 12 | 438.12 |
mp-1045897 | 7.265478 | 12.514383 | -1.150271 | other | Mg2Ni9O13 | 24 | 12 | 228.43 |
mp-540784 | 10.656863 | 12.261683 | 2.289344 | other | Rb2Ti6O13 | 21 | 12 | 274.17 |
mp-752603 | 10.482132 | 13.460459 | -2.205094 | other | Li3V2O6 | 11 | 12 | 105.47 |
mp-1214989 | 8.249583 | 1.349553 | -0.292643 | other | Ba3Pt1F12 | 16 | 12 | 378.49 |
mp-1246909 | -2.486471 | -3.210032 | -5.354568 | original | Y4S3N2 | 9 | 12 | 191.17 |
mp-27311 | 9.851046 | 9.07594 | 2.92423 | other | La2C2O2 | 6 | 12 | 104.33 |
mp-1101294 | 11.586334 | 8.585774 | 2.058307 | other | Zr2U8O20 | 30 | 12 | 389.58 |
mp-1246913 | 1.345773 | 2.511774 | 1.666849 | other | Mn1Pb2N2 | 5 | 12 | 87.95 |
mp-1248380 | 8.375731 | 8.311235 | -2.560856 | other | Al10Cu6O24 | 40 | 12 | 410.5 |
mp-28742 | -1.595484 | 0.14323 | 1.374164 | other | Ca4Ni3C5 | 12 | 12 | 186.8 |
mp-4647 | -5.362795 | -2.987054 | -4.303506 | original | K3Cu8Se6 | 17 | 12 | 350.81 |
mp-768727 | 12.986346 | 11.70685 | 1.487271 | other | Ti4V1O8 | 13 | 12 | 144.31 |
mp-1226549 | -2.205222 | 0.472725 | 2.386252 | other | Ce1Y1C4 | 6 | 12 | 87.27 |
mp-19335 | 7.833812 | 10.362313 | -3.768518 | other | K2Cr6O16 | 24 | 12 | 353.23 |
mp-1180580 | 9.631927 | 1.610178 | -1.163816 | other | Li1H1F2 | 4 | 12 | 32.86 |
mp-1217423 | -6.127225 | -1.986666 | 4.357422 | other | Ti8Cr4Ge10 | 22 | 12 | 338.79 |
mp-1205465 | -6.801487 | -4.950857 | 4.650057 | other | Ce4Mg7Ge6 | 17 | 12 | 407.06 |
mp-761032 | 1.472033 | 1.77266 | 3.011826 | other | Hf5N5O2 | 12 | 12 | 140.41 |
mp-1193402 | -6.127436 | -5.885142 | 3.817847 | other | Eu6Ga8Ge12 | 26 | 12 | 577.76 |
mp-1273834 | 6.422721 | 14.018466 | -1.983213 | other | Li2Co4O8 | 14 | 12 | 139.25 |
mp-1102988 | 7.273925 | 5.850496 | -4.752087 | other | Cd2S2O8 | 12 | 12 | 245.19 |
mp-2218876 | 12.751749 | 13.358449 | -1.114935 | other | Mg1V4O8 | 13 | 12 | 151.86 |
mp-1217179 | -5.755673 | -2.351979 | -1.430822 | other | Ti4Cr1Te8 | 13 | 12 | 335.58 |
mp-997094 | 8.347445 | 9.850844 | 0.518132 | other | Sr2Au2O4 | 8 | 12 | 131.15 |
mp-541622 | -6.119479 | -2.934811 | -2.255193 | other | K2Cu6Te4 | 12 | 12 | 281.89 |
mp-1042253 | 10.613205 | 9.472033 | 0.313892 | other | Mg2Sn4O8 | 14 | 12 | 204.24 |
mp-561973 | 9.683006 | 9.54769 | -1.800003 | other | K4Te8O24 | 36 | 12 | 521.85 |
mp-763950 | 13.235893 | 13.199921 | -1.818441 | other | V6O10F2 | 18 | 12 | 193.81 |
mp-1194667 | -5.256486 | -5.920299 | 0.726691 | other | Ca42Zn8Sb36 | 86 | 12 | 2,479.51 |
mp-10308 | -7.672398 | -3.603053 | 5.063073 | other | Ho4Ge4Rh2 | 10 | 12 | 202.27 |
mp-1388405 | 8.170633 | 13.373857 | -0.982384 | other | Mg2Fe4O8 | 14 | 12 | 167.33 |
mp-1209366 | 10.470989 | 10.539321 | 1.529322 | other | Pr3Re2O10 | 15 | 12 | 196.55 |
mp-1101049 | -3.966311 | -0.21597 | -4.387769 | other | Ti5Tl1S8 | 14 | 12 | 264.77 |
mp-1181918 | -1.118507 | 3.007258 | -3.057745 | other | Cs6Li4I10 | 20 | 12 | 887.96 |
mp-1021518 | -5.475602 | -0.091757 | -5.702959 | other | Cs1Cr5S8 | 14 | 12 | 280.31 |
mp-1207905 | -7.627662 | -3.29817 | 5.345547 | other | Y4Ge4Ru2 | 10 | 12 | 206.58 |
mp-1232140 | -4.53249 | -3.981448 | -3.932691 | other | Ho2Mg2Se6 | 10 | 12 | 287.64 |
mp-1218893 | -3.995805 | -5.238457 | 5.582842 | other | Sr1Ca2Si6 | 9 | 12 | 201.58 |
mp-31031 | 9.424872 | 8.927081 | 2.543147 | other | La4Pd1O7 | 12 | 12 | 188.91 |
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